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2020 – today
- 2023
[j7]Ambre Blanc, Antonio Monari, Jean Christophe Tremblay:
A posteriori localization of many-body excited states through simultaneous diagonalization. J. Comput. Chem. 44(2): 105-116 (2023)- 2021
- [j6]Jingjing Shao
, Beate Paulus, Jean Christophe Tremblay:
Local current analysis on defective zigzag graphene nanoribbons devices for biosensor material applications. J. Comput. Chem. 42(21): 1475-1485 (2021) - [j5]Erik Hermann, Gunter Hermann, Jean Christophe Tremblay:
Ethical Artificial Intelligence in Chemical Research and Development: A Dual Advantage for Sustainability. Sci. Eng. Ethics 27(4): 45 (2021) - [j4]Dietrich Haase, Gunter Hermann, Jörn Manz, Vincent Pohl, Jean Christophe Tremblay:
Electron Symmetry Breaking during Attosecond Charge Migration Induced by Laser Pulses: Point Group Analyses for Quantum Dynamics. Symmetry 13(2): 205 (2021)
2010 – 2019
- 2017
- [j3]Vincent Pohl, Gunter Hermann, Jean Christophe Tremblay:
An open-source framework for analyzing N-electron dynamics. I. Multideterminantal wave functions. J. Comput. Chem. 38(17): 1515-1527 (2017) - [j2]Gunter Hermann, Vincent Pohl, Jean Christophe Tremblay:
An open-source framework for analyzing N-electron dynamics. II. Hybrid density functional theory/configuration interaction methodology. J. Comput. Chem. 38(28): 2378-2387 (2017) - 2016
- [j1]Gunter Hermann, Vincent Pohl, Jean Christophe Tremblay, Beate Paulus, Hans-Christian Hege, Axel Schild:
ORBKIT: A modular python toolbox for cross-platform postprocessing of quantum chemical wavefunction data. J. Comput. Chem. 37(16): 1511-1520 (2016)
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